methyl (2R)-2-[[3,3-dimethyl-5-[(4-methylphenyl)amino]-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[[3,3-dimethyl-5-[(4-methylphenyl)amino]-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[3,3-dimethyl-5-(4-methylanilino)-5-oxo-pentanoyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[3,3-dimethyl-5-(4-methylanilino)-1,5-dioxopentyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[3,3-dimethyl-5-(4-methylanilino)-5-oxopentanoyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[5-keto-3,3-dimethyl-5-(p-toluidino)pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CC(C)(C)CC(=O)NC(CC(C)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CC(C)(C)CC(=O)N[C@H](CC(C)C)C(=O)OC

InChI

InChI=1S/C21H32N2O4/c1-14(2)11-17(20(26)27-6)23-19(25)13-21(4,5)12-18(24)22-16-9-7-15(3)8-10-16/h7-10,14,17H,11-13H2,1-6H3,(H,22,24)(H,23,25)/t17-/m1/s1